3-tert-butyl-1-pyridin-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 3-tert-butyl-1-pyridin-2-yl-pyrazole-4-carboxylic acid Openeye Name: 3-tert-butyl-1-(2-pyridyl)pyrazole-4-carboxylic acid CAS Name: 3-tert-butyl-1-(2-pyridinyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-tert-butyl-1-pyridin-2-ylpyrazole-4-carboxylic acid Traditional Name: 3-tert-butyl-1-(2-pyridyl)pyrazole-4-carboxylic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1C(=O)O)C2=CC=CC=N2

Isomeric SMILES

CC(C)(C)C1=NN(C=C1C(=O)O)C2=CC=CC=N2

InChI

InChI=1S/C13H15N3O2/c1-13(2,3)11-9(12(17)18)8-16(15-11)10-6-4-5-7-14-10/h4-8H,1-3H3,(H,17,18)